Vitas-M small molecule compound
4-({[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STL299121
SMILES N#Cc1ccc(cc1)CSc1nnc(n1C)c1ccc(cc1)C(C)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H22N4S MW 362.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4S/c1-21(2,3)18-11-9-17(10-12-18)19-23-24-20(25(19)4)26-14-16-7-5-15(13-22)6-8-16/h5-12H,14H2,1-4H3InChIKey
KXGQDPKMVGNQIU-UHFFFAOYSA-NSynonyms
736147-77-64(((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)methyl)benzonitrile
4(((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
4((5(4(TERTBUTYL)PHENYL)4METHYL124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
4((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
736147776
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC3=CC=C(C=C3)C#N
InChI=1SC21H22N4Sc121(23)1811917(101218)19232420(25(19)4)2614167515(1322)6816h512H14H214H3
MFCD04606805
ZINC000003323457
ZINC03323457
ZINC3323457
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